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40398-02-5 | 2,3,5,6-Tetrachlorophenyl isocyanate
CAS No: 40398-02-5 Catalog No: AG003FEJ MDL No:MFCD01863691
Product Description
Catalog Number:
AG003FEJ
Chemical Name:
2,3,5,6-Tetrachlorophenyl isocyanate
CAS Number:
40398-02-5
MDL Number:
MFCD01863691
IUPAC Name:
1,2,4,5-tetrachloro-3-isocyanatobenzene
InChI:
InChI=1S/C7HCl4NO/c8-3-1-4(9)6(11)7(5(3)10)12-2-13/h1H
InChI Key:
GQWLHPWGYHTUAS-UHFFFAOYSA-N
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.878g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.891g/mol
Monoisotopic Mass:
254.881g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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